1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one

C20H22N2O4 — CID 91755025

IUPAC1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one
SMILESCOc1cc(/C=C\c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC
InChIInChI=1S/C20H22N2O4/c1-24-17-12-15(13-18(25-2)19(17)26-3)5-4-14-6-8-16(9-7-14)22-11-10-21-20(22)23/h4-9,12-13H,10-11H2,1-3H3,(H,21,23)/b5-4-
InChIKeyDGQCLYJBZHNLFX-PLNGDYQASA-N
MW354.41 g/mol
LogP3.41
Rot. Bonds6

About 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one

1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one (PubChem CID 91755025) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one
PubChem CID91755025
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC Name1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one
SMILESCOc1cc(/C=C\c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC
InChIInChI=1S/C20H22N2O4/c1-24-17-12-15(13-18(25-2)19(17)26-3)5-4-14-6-8-16(9-7-14)22-11-10-21-20(22)23/h4-9,12-13H,10-11H2,1-3H3,(H,21,23)/b5-4-
InChIKeyDGQCLYJBZHNLFX-PLNGDYQASA-N
XLogP3.41
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

4-Methoxy-N-(3,4,5-trimethoxybenzyl)aniline
CID 364716
Dimethyl-{4-[2-(3,4,5-trimethoxy-phenyl)-vinyl]-phenyl}-amine
CID 15696370
4-Methyl-N-(3,4,5-trimethoxybenzyl)aniline
CID 373798
4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline
CID 373800
1,3-Diphenyl-2-(3,4,5-trimethoxyphenyl)imidazolidine
CID 292557
4-(3,4-dimethoxyphenyl)-1-(3-methylphenyl)-1,3-dihydro-2H-imidazol-2-one
CID 2135734
4-methoxy-N-[(3,4,5-trimethoxyphenyl)methyl]aniline hydrochloride
CID 372855
4-Methyl-N-(3,4,5-trimethoxybenzyl)aniline hydrochloride
CID 373799
4-Ethyl-N-(3,4,5-trimethoxybenzyl)aniline hydrochloride
CID 373801
N,N-dimethyl-4-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]aniline
CID 15696371
6-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]-1H-benzimidazol-2-one
CID 18467672
2-amino-N-[2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]acetamide
CID 68521859

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one?
The IUPAC name of 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one (CID 91755025) is 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one is COc1cc(/C=C\c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC.
What is the InChIKey of 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one?
The InChIKey is DGQCLYJBZHNLFX-PLNGDYQASA-N. The full InChI is InChI=1S/C20H22N2O4/c1-24-17-12-15(13-18(25-2)19(17)26-3)5-4-14-6-8-16(9-7-14)22-11-10-21-20(22)23/h4-9,12-13H,10-11H2,1-3H3,(H,21,23)/b5-4-.
What are the key properties of 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one?
1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one has a molecular weight of 354.41 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]imidazolidin-2-one is sourced from PubChem (CID 91755025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).